N-(4-chloranyl-2-fluoranyl-5-propan-2-yloxy-phenyl)-1,2-diazinane-1-carbothioamide

Systemtic Name: N-(4-chloranyl-2-fluoranyl-5-propan-2-yloxy-phenyl)-1,2-diazinane-1-carbothioamide Openeye Name: N-(4-chloro-2-fluoro-5-isopropoxy-phenyl)hexahydropyridazine-1-carbothioamide CAS Name: N-(4-chloro-2-fluoro-5-propan-2-yloxyphenyl)-1-diazinanecarbothioamide IUPAC Name: N-(4-chloro-2-fluoro-5-propan-2-yloxyphenyl)diazinane-1-carbothioamide Traditional Name: N-(4-chloro-2-fluoro-5-isopropoxy-phenyl)hexahydropyridazine-1-carbothioamide Formula: C14H19ClFN3OS MolecularWeight: 331.836563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C(=C1)NC(=S)N2CCCCN2)F)Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C(=C1)NC(=S)N2CCCCN2)F)Cl

InChI

InChI=1S/C14H19ClFN3OS/c1-9(2)20-13-8-12(11(16)7-10(13)15)18-14(21)19-6-4-3-5-17-19/h7-9,17H,3-6H2,1-2H3,(H,18,21)